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3.alpha.-Hydroxyilicic acid
SpectraBase Compound ID GUDVPDd5zsq
InChI InChI=1S/C15H24O4/c1-9(13(17)18)10-4-6-14(2)7-5-12(16)15(3,19)11(14)8-10/h10-12,16,19H,1,4-8H2,2-3H3,(H,17,18)/t10-,11?,12-,14+,15+/m1/s1
InChIKey SVUDFAVZLCGQAU-SUWDNJBVSA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ucEH4QGf5j
Name 3.alpha.-Hydroxy-epi-Ilicic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-9(13(17)18)10-4-6-14(2)7-5-12(16)15(3,19)11(14)8-10/h10-12,16,19H,1,4-8H2,2-3H3,(H,17,18)/t10-,11?,12-,14+,15+/m1/s1
InChIKey SVUDFAVZLCGQAU-SUWDNJBVSA-N
Molecular Weight 268.353 g/mol
SMILES O[C@@]1(CC[C@]2(C([C@@]1(O)C)C[C@@](CC2)(C(C(=O)O)=C)[H])C)[H]
SPLASH splash10-0f80-4090000000-50f4b1bf5f07c84c611a
Source of Spectrum G4-61-800-3
Synonyms 3.beta.-Hydroxy-Ilicic Acid 3,4-Dihydroxy-6-[1'-(hydroxycarbonyl)ethenyl]-3-methyl-(perhydro)-naphthalene 2-[(2R,4aS,7R,8S)-7,8-dihydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]-2-propenoic acid 2-[(2R,4aS,7R,8S)-4a,8-dimethyl-7,8-bis(oxidanyl)-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid 2-[(2R,4aS,7R,8S)-7,8-dihydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid 2-[(2R,4aS,7R,8S)-7,8-dihydroxy-4a,8-dimethyl-decalin-2-yl]acrylic acid 2-[(2R,4aS,7R,8S)-7,8-dihydroxy-4a,8-dimethyl-decalin-2-yl]prop-2-enoic acid
Wiley ID 1607308